CHEBI:2721 - Angoline

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ChEBI Name Angoline
ChEBI ID CHEBI:2721
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C22H21NO5
Net Charge 0
Average Mass 379.407
Monoisotopic Mass 379.14197
InChI InChI=1S/C22H21NO5/c1-23-20-14(6-5-12-9-17-18(10-15(12)20)28-11-27-17)13-7-8-16(24-2)21(25-3)19(13)22(23)26-4/h5-10,22H,11H2,1-4H3
InChIKey LVWAKZBZWYHYCJ-UHFFFAOYSA-N
SMILES COC1N(C)c2c(ccc3cc4OCOc4cc23)-c2ccc(OC)c(OC)c12
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing Angoline (CHEBI:2721) is a benzophenanthridine alkaloid (CHEBI:38517)
Synonym Source
Angoline KEGG COMPOUND
Manual Xrefs Databases
C00001804 KNApSAcK
C09336 KEGG COMPOUND
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Registry Number Type Source
21080-31-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014